Molecule ID: mol8088

SMILES: Cc1nc2c(OC(C)C)nc(N)nc2nc1O

InChI: InChI=1S/C10H13N5O2/c1-4(2)17-9-6-7(14-10(11)15-9)13-8(16)5(3)12-6/h4H,1-3H3,(H3,11,13,14,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.14 IUPAC digitized pKa 2 » 1
7.80 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization